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Revised crystal structure of the human adiponectin receptor 2 in complex with a C18 free fatty acid

Analyse Revised crystal structure of the human adiponectin receptor 2 in complex with a… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5LWY
Type
protein
Length
511 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adiponectin receptor protein 2; V region heavy chain; V region light chain
UniProt
Q86V24
Ligands
OLB, OLA, ZN
Pockets
5 · best druggability 0.85

Structure

x-ray diffraction · 3 distinct chains · 42% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAdiponectin receptor protein 2protein28571% helix, 1% strandQ86V24
HV region heavy chainprotein1198% helix, 48% strand—
LV region light chainprotein1073% helix, 51% strand—

Ligands and binding sites

  • OLB · (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate · ligand · 8 copies · chains A, L
  • OLA · Oleic acid · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • GOL · Glycerol · additive · chains L

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

5 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16190.850.8991ZN, OLB, OLA
21080.480.8018empty
31670.470.7639GOL
41000.350.7422empty
5830.350.7518empty

Interfaces

3 interfaces between chains.

  • H–L · 808 Ų buried · 9 hydrogen bonds · protein-protein
  • A–L · 499 Ų buried · 6 hydrogen bonds · protein-protein
  • A–H · 476 Ų buried · 11 hydrogen bonds · protein-protein

Compared structures

  • 5LWY · Revised crystal structure of the human adiponectin receptor 2 in complex with a C18 free… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q86V24 · AlphaFold monomer V2.0 prediction for adiponectin receptor protein 2 (Q86V24) · a predicted model of the same protein · chain A against A, TM-score 0.99

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